SCHEMBL8645856

SCHEMBL8645856

COC(=O)C1(C(=O)OC)Cc2cc(CC(C)=O)ccc2N1C(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
LMNA P02545 6/20 0.40
GAA P10253 1/20 0.40
TP53 P04637 2/20 0.37
POLB P06746 4/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.36
MEN1 O00255 1/20 0.36
CYP3A4 P08684 1/20 0.36
KMT2A Q03164 1/20 0.36
PDE5A O76074 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8647266 0.87 KMT2A (0.37) LMNAGAAALDH1A1SMN1; SMN2MEN1
SCHEMBL8645908 0.84 MAPT (0.35) MAPTLMNATP53POLB
SCHEMBL8646109 0.82 GAA (0.42) MAPTLMNAGAATP53TSHR
SCHEMBL8644943 0.81 AMPD2 (0.39) POLB
SCHEMBL8648264 0.81 MAPT (0.33) MAPTLMNAGAATP53POLB
SCHEMBL8644950 0.80 AMPD2 (0.38) MAPTPOLB
SCHEMBL8647457 0.80 LMNA (0.33) MAPTLMNATP53POLBTSHR
SCHEMBL8645865 0.79 MAPT (0.38) MAPTTP53ALDH1A1SMN1; SMN2MEN1
SCHEMBL8645858 0.72 ALDH1A1 (0.42) MAPTLMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL8646423 0.72 LMNA (0.48) LMNATP53POLBALDH1A1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5843972-A Heterocyclic β-adrenergic agonists PFIZER INC. (US) 1998-12-01 US disclosed
EP-0801060-A1 Heterocyclic Beta-3 Adrenergenic Agonists PFIZER INC. (US) 1997-10-15 EP disclosed